1-[2-[4-(5-chloranyl-2-methyl-phenyl)piperazin-1-yl]-2-oxidanylidene-ethyl]-4,5-dihydro-3H-1-benzazepin-2-one

Systemtic Name: 1-[2-[4-(5-chloranyl-2-methyl-phenyl)piperazin-1-yl]-2-oxidanylidene-ethyl]-4,5-dihydro-3H-1-benzazepin-2-one Openeye Name: 1-[2-[4-(5-chloro-2-methyl-phenyl)piperazin-1-yl]-2-oxo-ethyl]-4,5-dihydro-3H-1-benzazepin-2-one CAS Name: 1-[2-[4-(5-chloro-2-methylphenyl)-1-piperazinyl]-2-oxoethyl]-4,5-dihydro-3H-1-benzazepin-2-one IUPAC Name: 1-[2-[4-(5-chloro-2-methylphenyl)piperazin-1-yl]-2-oxoethyl]-4,5-dihydro-3H-1-benzazepin-2-one Traditional Name: 1-[2-[4-(5-chloro-2-methyl-phenyl)piperazino]-2-keto-ethyl]-4,5-dihydro-3H-1-benzazepin-2-one Formula: C23H26ClN3O2 MolecularWeight: 411.92444

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)Cl)N2CCN(CC2)C(=O)CN3C(=O)CCCC4=CC=CC=C43

Isomeric SMILES

CC1=C(C=C(C=C1)Cl)N2CCN(CC2)C(=O)CN3C(=O)CCCC4=CC=CC=C43

InChI

InChI=1S/C23H26ClN3O2/c1-17-9-10-19(24)15-21(17)25-11-13-26(14-12-25)23(29)16-27-20-7-3-2-5-18(20)6-4-8-22(27)28/h2-3,5,7,9-10,15H,4,6,8,11-14,16H2,1H3